205106 logo
canSAR205106
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=O)CCCC1(C(=O)N[C@@H](Cc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)C(=O)O)CCCC1
    InChI
    InChI=1S/C27H30Cl2N2O5/c1-17(32)6-5-15-27(13-2-3-14-27)26(36)31-22(25(34)35)16-18-9-11-19(12-10-18)30-24(33)23-20(28)7-4-8-21(23)29/h4,7-12,22H,2-3,5-6,13-16H2,1H3,(H,30,33)(H,31,36)(H,34,35)/t22-/m0/s1
    MOLECULAR FORMULA
    C27H30Cl2N2O5
    CROSS REFERENCES
    205106 logo

    canSAR205106

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.15
    AlogP 5.68
    HBond donors 3
    HBond acceptors 7
    Atoms 66
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR205106.